[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] (E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-2-propenoic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] (E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)acrylic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H19ClN2O6 MolecularWeight: 382.79556

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C=CC1=CC2=C(C(=C1)Cl)OCO2

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)/C=C/C1=CC2=C(C(=C1)Cl)OCO2

InChI

InChI=1S/C17H19ClN2O6/c1-2-3-6-19-17(23)20-14(21)9-24-15(22)5-4-11-7-12(18)16-13(8-11)25-10-26-16/h4-5,7-8H,2-3,6,9-10H2,1H3,(H2,19,20,21,23)/b5-4+